Found 56 results

Search term: MF = 'C_{31}H_{34}O_{8}'
ChemSpider 2D Image | 4-{3-Benzoyl-2,6-dihydroxy-4-[(3-methyl-2-buten-1-yl)oxy]benzyl}-3,5-dihydroxy-2-isobutyryl-6,6-dimethyl-2,4-cyclohexadien-1-one | C31H34O8

4-{3-Benzoyl-2,6-dihydroxy-4-[(3-methyl-2-buten-1-yl)oxy]benzyl}-3,5-dihydroxy-2-isobutyryl-6,6-dimethyl-2,4-cyclohexadien-1-one

  • Molecular FormulaC31H34O8
  • Average mass534.597 Da
  • Monoisotopic mass534.225342 Da
  • ChemSpider ID314631

More details:

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

2,4-Cyclohexadien-1-one, 4-[[3-benzoyl-2,6-dihydroxy-4-[(3-methyl-2-buten-1-yl)oxy]phenyl]methyl]-3,5-dihydroxy-6,6-dimethyl-2-(2-methyl-1-oxopropyl)- [ACD/Index Name]
4-{3-Benzoyl-2,6-dihydroxy-4-[(3-methyl-2-buten-1-yl)oxy]benzyl}-3,5-dihydroxy-2-isobutyryl-6,6-dimethyl-2,4-cyclohexadien-1-on [German] [ACD/IUPAC Name]
4-{3-Benzoyl-2,6-dihydroxy-4-[(3-methyl-2-buten-1-yl)oxy]benzyl}-3,5-dihydroxy-2-isobutyryl-6,6-dimethyl-2,4-cyclohexadien-1-one [ACD/IUPAC Name]
4-{3-Benzoyl-2,6-dihydroxy-4-[(3-méthyl-2-butén-1-yl)oxy]benzyl}-3,5-dihydroxy-2-isobutyryl-6,6-diméthyl-2,4-cyclohexadién-1-one [French] [ACD/IUPAC Name]
4-[[3-BENZOYL-2,6-DIHYDROXY-4-(3-METHYLBUT-2-ENOXY)PHENYL]METHYL]-3,5-DIHYDROXY-6,6-DIMETHYL-2-(2-METHYLPROPANOYL)CYCLOHEXA-2,4-DIEN-1-ONE
96624-40-7 [RN]
Sarothralin

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

C09969 [DBID]
NSC606405 [DBID]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.3±0.1 g/cm3
Boiling Point: 796.1±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.9 mmHg at 25°C
Enthalpy of Vaporization: 119.8±3.0 kJ/mol
Flash Point: 259.1±26.4 °C
Index of Refraction: 1.619
Molar Refractivity: 145.8±0.3 cm3
#H bond acceptors: 8
#H bond donors: 4
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 2
ACD/LogP: 6.26
ACD/LogD (pH 5.5): 3.36
ACD/BCF (pH 5.5): 92.14
ACD/KOC (pH 5.5): 333.50
ACD/LogD (pH 7.4): 1.26
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 2.64
Polar Surface Area: 141 Å2
Polarizability: 57.8±0.5 10-24cm3
Surface Tension: 57.7±3.0 dyne/cm
Molar Volume: 415.3±3.0 cm3

Click to predict properties on the Chemicalize site


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